2-(2-ethoxyphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)quinoline-4-carboxamide

Systemtic Name: 2-(2-ethoxyphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)quinoline-4-carboxamide Openeye Name: 2-(2-ethoxyphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)quinoline-4-carboxamide CAS Name: 2-(2-ethoxyphenyl)-N-(1-ethyl-4-piperidin-1-iumyl)-4-quinolinecarboxamide IUPAC Name: 2-(2-ethoxyphenyl)-N-(1-ethylpiperidin-1-ium-4-yl)quinoline-4-carboxamide Traditional Name: N-(1-ethylpiperidin-1-ium-4-yl)-2-o-phenetyl-cinchoninamide Formula: C25H30N3O2+ MolecularWeight: 404.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4OCC

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4OCC

InChI

InChI=1S/C25H29N3O2/c1-3-28-15-13-18(14-16-28)26-25(29)21-17-23(27-22-11-7-5-9-19(21)22)20-10-6-8-12-24(20)30-4-2/h5-12,17-18H,3-4,13-16H2,1-2H3,(H,26,29)/p+1